3-methyl-4-(4-nitrophenyl)sulfonyl-N-propan-2-yl-aniline

Systemtic Name: 3-methyl-4-(4-nitrophenyl)sulfonyl-N-propan-2-yl-aniline Openeye Name: N-isopropyl-3-methyl-4-(4-nitrophenyl)sulfonyl-aniline CAS Name: 3-methyl-4-(4-nitrophenyl)sulfonyl-N-propan-2-ylaniline IUPAC Name: 3-methyl-4-(4-nitrophenyl)sulfonyl-N-propan-2-ylaniline Traditional Name: isopropyl-(3-methyl-4-nosyl-phenyl)amine Formula: C16H18N2O4S MolecularWeight: 334.39012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(C)C)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)NC(C)C)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H18N2O4S/c1-11(2)17-13-4-9-16(12(3)10-13)23(21,22)15-7-5-14(6-8-15)18(19)20/h4-11,17H,1-3H3